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98105-99-8,MFCD00865974
Catalog No.:AA00H5PY

98105-99-8 | 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid

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100mg
98%
in stock  
$68.00   $48.00
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250mg
98%
in stock  
$113.00   $79.00
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1g
97%
in stock  
$170.00   $119.00
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5g
97%
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$494.00   $346.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00H5PY
Chemical Name:
6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
CAS Number:
98105-99-8
Molecular Formula:
C20H17F2N3O3
Molecular Weight:
385.3641
MDL Number:
MFCD00865974
SMILES:
Fc1ccc(cc1)n1cc(C(=O)O)c(=O)c2c1cc(N1CCNCC1)c(c2)F
Properties
Properties
 
BP:
621.4°C at 760 mmHg  
Form:
Solid  
MP:
>230°C (dec.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
645  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
0.3  

Downstream Synthesis Route

[1]Chu,DanielT.W.;Fernandes,PrabhavathiB.;Claiborne,AkiyoK.;Pihuleac,Eva;Nordeen,CarlW.;etal.[JournalofMedicinalChemistry,1985,vol.28,#11,p.1558-1564]

[1]Chu,DanielT.W.;Fernandes,PrabhavathiB.;Claiborne,AkiyoK.;Pihuleac,Eva;Nordeen,CarlW.;etal.[JournalofMedicinalChemistry,1985,vol.28,#11,p.1558-1564]

[1]Renau,ThomasE.;Sanchez,JosephP.;Shapiro,MartinA.;Dever,JulieA.;Gracheck,StephenJ.;Domagala,JohnM.[JournalofMedicinalChemistry,1995,vol.38,#15,p.2974-2977]

[1]MacDonald,AlasdairA.;DeWitt,SheilaH.;Hogan,EleonoraM.;Ramage,Robert[TetrahedronLetters,1996,vol.37,#27,p.4815-4818]

110-85-0    98105-79-4    98105-99-8   
7-Chloro-1-(4-fluoro-phenyl)-4-oxo-6-piperazin-1-yl-1,4-dihydro-quinoline-3-carboxylicacid 

[1]Hermecz,Istvan;Vasvari-Debreczy,Lelle;Podanyi,Benjamin;Kereszturi,Geza;Balogh,Maria;Horvath,Agnes;Varkonyi,Peter[Heterocycles,1998,vol.48,#6,p.1111-1116]

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SDS
Tags:98105-99-8 Molecular Formula|98105-99-8 MDL|98105-99-8 SMILES|98105-99-8 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid